SCHEMBL15090335

SCHEMBL15090335

C=CCO[C@]1(C(=O)OC)C[C@@H](O)C(NC(C)=O)C([C@H](O)[C@H](O)CN=[N+]=[N-])O1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NANP Q8TBE9 3/20 0.55
▸ NEU4 Q8WWR8 1/20 0.43
▸ NEU3 Q9UQ49 1/20 0.43
▸ NEU2 Q9Y3R4 1/20 0.43
▸ SIGLEC7 Q9Y286 7/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16839998 1.00 NANP (0.55) NANPNEU4NEU3NEU2SIGLEC7
SCHEMBL16362511 1.00 NANP (0.55) NANPNEU4NEU3NEU2SIGLEC7
SCHEMBL15087689 1.00 NANP (0.55) NANPNEU4NEU3NEU2SIGLEC7
SCHEMBL18357291 1.00 NANP (0.55) NANPNEU4NEU3NEU2SIGLEC7
SCHEMBL17057676 0.88 NANP (0.69) NANPNEU4NEU3NEU2SIGLEC7
SCHEMBL16373220 0.87 NANP (0.58) NANPSIGLEC7
SCHEMBL16840021 0.87 NANP (0.58) NANPSIGLEC7
SCHEMBL15087685 0.87 NANP (0.58) NANPSIGLEC7
SCHEMBL18357267 0.87 NANP (0.58) NANPSIGLEC7
SCHEMBL16362509 0.87 NANP (0.58) NANPSIGLEC7

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2797946-B1 SIALIC ACID DIMERS BROSSMER REINHARD (DE) 2016-05-04 — — EP disclosed
WO-2013097942-A1 SIALIC ACID DIMERS BROSSMER REINHARD (DE) 2013-07-04 — — WO disclosed
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